3-(Bromomethyl)oxetane

Basic Information

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CAS Number

1374014-30-8

Molecular Formula

C4H7BrO

Molecular Weight

151 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

SMILES

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C1C(CO1)CBr

InChI

InChI=1S/C4H7BrO/c5-1-4-2-6-3-4/h4H,1-3H2

InChIKey

IEDRUQXJIWTVIL-UHFFFAOYSA-N

LogP

1.0276999999999998

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

42.8

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

3-(Bromomethyl)oxetane
3-Bromomethyl-oxetane
Oxetane, 3-(bromomethyl)-
IEDRUQXJIWTVIL-UHFFFAOYSA-N
2022AJ
SB15841
AM807116
AK136602
ST2410378
3-(bromomethyl)oxetane
DB-262197
CS-W018850
1374014-30-8
AKOS022171945
A886503
MFCD20278240
DTXSID30601180
SCHEMBL6667822
DS-5545
SY059797
ZEC01430
P12750
EN300-330173

MDL Number

MFCD20278240

FAQ

What are the physical and chemical properties of 3-(Bromomethyl)oxetane (CAS: 1374014-30-8)?

3-(Bromomethyl)oxetane (CAS: 1374014-30-8) is a colorless liquid with a molecular weight of 131.01 g/mol. It has a low solubility in water but is soluble in organic solvents. The compound is moderately reactive, particularly towards nucleophiles and reducing agents, making it useful in organic synthesis.

How is 3-(Bromomethyl)oxetane (CAS: 1374014-30-8) typically synthesized?

3-(Bromomethyl)oxetane (CAS: 1374014-30-8) can be synthesized via the bromination of oxetane using N-bromosuccinimide (NBS) in the presence of a radical initiator such as azobisisobutyronitrile (AIBN). The reaction is carried out under light or heat to promote radical formation. Yields are typically high, and the product can be isolated by simple purification techniques.

What industries use 3-(Bromomethyl)oxetane (CAS: 1374014-30-8)?

3-(Bromomethyl)oxetane (CAS: 1374014-30-8) is primarily used in the pharmaceutical industry for the synthesis of certain drugs and intermediates. It is also utilized in the polymer industry for the production of advanced materials and in the chemical sensor industry for developing gas-sensing devices.

What precautions should be taken when handling 3-(Bromomethyl)oxetane (CAS: 1374014-30-8)?

When handling 3-(Bromomethyl)oxetane (CAS: 1374014-30-8), it is essential to use proper personal protective equipment (PPE), including gloves, goggles, and a laboratory coat. Work should be conducted in a fume hood to minimize exposure. Spills should be cleaned up immediately using appropriate absorbent materials. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.